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Virtual screening of Indonesian flavonoid as neuraminidase inhibitor of influenza a subtype H5N1

机译:印度尼西亚黄酮作为甲型流感神经氨酸酶抑制剂的虚拟筛选A亚型H5N1

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Highly Pathogenic Avian Influenza (HPAI) H5N1 poses a significant threat to animal and human health worldwide. The number of H5N1 infection in Indonesia is the highest during 2005-2013, with a mortality rate up to 83%. A mutation that occurred in H5N1 strain made it resistant to commercial antiviral agents such as oseltamivir and zanamivir, so the more potent antiviral agent is needed. In this study, virtual screening of Indonesian flavonoid as neuraminidase inhibitor of H5N1 was conducted. Total 491 flavonoid compound obtained from HerbalDB were screened. Molecular docking was performed using MOE 2008.10. This research resulted in Guajavin B as the best ligand.
机译:高致病性禽流感(HPAI)H5N1对全世界动物和人类健康构成了重大威胁。印度尼西亚的H5N1感染的数量是2005 - 2013年的最高,死亡率高达83%。在H5N1菌株中发生的突变使其耐用于商业抗病毒剂,例如Oseltamivir和Zanamivir,因此需要更有效的抗病毒剂。在该研究中,进行了印度尼西亚黄酮类黄酮作为H5N1的神经氨酸酶抑制剂的虚拟筛选。筛选了从米尔巴达中获得的491种异己烷化合物。使用MOE 2008.10进行分子对接。这项研究导致Guajavin B作为最好的配体。

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